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Screening compounds

Npc13710

Also known as Pseudolaric acid B-O-beta-D-glucopyranoside, Pseudolaric acid B |A-D-glucoside, pseudolaric acid B O-beta-d-glucopyranoside

CAS 98891-41-9Formula C29H38O13Molar mass 594.61 g/molEC 683-260-3
GHS signal word: Danger. Pictograms: Acute toxicity (severe), Serious health hazard 2 suppliers listed
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Npc13710 chemical structure, C29H38O13, CAS 98891-41-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
98891-41-9
Formula
C29H38O13
Molar mass
594.61 g/mol
EC number
683-260-3
HS code
293299
Category
Screening compounds

What is Npc13710?

Plain description, key identifiers and synonyms

pseudolaric acid B beta-D-glucoside has been reported in Pseudolarix amabilis and Larix kaempferi.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl (1R,7S,8S,9R)-7-acetyloxy-9-methyl-9-[(1E,3E)-4-methyl-5-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypenta-1,3-dienyl]-11-oxo-10-oxatricyclo[6.3.2.01,7]tridec-3-ene-4-carboxylate
CAS number
98891-41-9
EC number
683-260-3
Molecular formula
C29H38O13
MDL number
MFCD22124713
InChIKey
UUDZDKPKXAEKLA-YHLOYHKPSA-N
InChI
InChI=1S/C29H38O13/c1-15(23(35)40-25-22(34)21(33)20(32)18(14-30)39-25)6-5-10-27(3)19-9-12-28(26(37)42-27)11-7-17(24(36)38-4)8-13-29(19,28)41-16(2)31/h5-7,10,18-22,25,30,32-34H,8-9,11-14H2,1-4H3/b10-5+,15-6+/t18-,19+,20-,21+,22-,25+,27-,28-,29+/m1/s1
Canonical SMILES
COC(=O)C1=CCC23CCC(C(C)(C=CC=C(C)C(=O)OC4OC(CO)C(O)C(O)C4O)OC2=O)C3(OC(C)=O)CC1
Isomeric SMILES
C/C(=C\C=C\[C@@]1([C@@H]2CC[C@@]3([C@@]2(CCC(=CC3)C(=O)OC)OC(=O)C)C(=O)O1)C)/C(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

Synonyms

  • Pseudolaric acid B-O-beta-D-glucopyranoside
  • Pseudolaric acid B |A-D-glucoside
  • pseudolaric acid B O-beta-d-glucopyranoside
  • Pseudolaric acid B beta-D-glucoside
  • Pseudolaric acid B-O-|A-D-glucopyranoside
  • Pseudolaric acid b-o-beta-d- glucopyranoside
  • PseudolaricacidBO-beta-D-glucopyranoside
  • Pseudolaric acid B |?-D-glucoside
  • Pseudolaricacidb-o-beta-d-glucopyranoside

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
594.61 g/molcalc.
Exact mass
594.2312 Dacalc.
LogP (octanol/water)
0.13calc.
Topological polar surface area
195.4 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
13calc.
Rotatable bonds
7calc.
Heavy atoms
42calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.66calc.
Formal charge
0calc.
Stereocentres
9calc.
Lipinski rule of five
Fails (2 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C(C=CC=CC1OC(=O)C23CC=CCCC2C1CC3)OC1CCCCO1

O=C(C=CC=CC1OC(=O)C23CC=CCCC2C1CC3)OC1CCCCO1

4 rings, 27 atoms.

3 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Danger
GHS06: Acute toxicity (severe)
Acute toxicity (severe)
GHS08: Serious health hazard
Serious health hazard

Hazard statements

  • H301Toxic if swallowed.
  • H361Suspected of damaging fertility or the unborn child.
Precautionary statements (10)
  • P203Obtain, read and follow all safety instructions before use.
  • P264Wash skin thoroughly after handling.
  • P270Do not eat, drink or smoke when using this product.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P301 + P316If swallowed: Get emergency medical help immediately.
  • P318If exposed or concerned, get medical advice.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P330Rinse mouth.
  • P405Store locked up.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

Npc13710 suppliers

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All 2 suppliers

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Where suppliers are based

2 suppliers in 1 country

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Npc13710 price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Npc13710 is traded under.

HS 2932.99Indicative HS code

Heterocyclic compounds with oxygen hetero-atom(s) only, other

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Npc13710 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Npc13710, based on the data on this page

What is Npc13710?

pseudolaric acid B beta-D-glucoside has been reported in Pseudolarix amabilis and Larix kaempferi.

What is the CAS number of Npc13710?

The CAS registry number of Npc13710 is 98891-41-9.

What is the molecular formula and weight of Npc13710?

The molecular formula of Npc13710 is C29H38O13 and its molar mass is 594.61 g/mol.

What is Npc13710 used for?

Known uses and roles of Npc13710 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Npc13710 hazardous?

Npc13710 carries the GHS signal word "Danger". Main hazards: toxic if swallowed, suspected of damaging fertility or the unborn child. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Npc13710?

Npc13710 is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Npc13710?

CompoundList lists 2 suppliers of Npc13710 in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Npc13710?

Suppliers quote Npc13710 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Npc13710

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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