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Heterocyclic building blocks

Sculponin D

CAS 1182713-59-2Formula C40H48O12Molar mass 720.81 g/mol
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Sculponin D chemical structure, C40H48O12, CAS 1182713-59-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1182713-59-2
Formula
C40H48O12
Molar mass
720.81 g/mol
HS code
293220
Category
Heterocyclic building blocks

What is Sculponin D?

Plain description, key identifiers and synonyms

UKVLVCQUVUORIL-GRBPIKCNSA-N has been reported in Isodon sculponeatus.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,1'S,2S,3R,4'S,5S,6S,7'R,8S,10'S,11S,13'S,14R,14'S,15'R,17S,17'S,20R,25'R)-3,15'-dihydroxy-7',14-dimethylspiro[10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-6,21'-3,9,11,22-tetraoxaheptacyclo[15.6.1.17,10.01,14.04,13.018,23.013,25]pentacos-18(23)-ene]-2',7,9-trione
CAS number
1182713-59-2
Molecular formula
C40H48O12
InChIKey
UKVLVCQUVUORIL-GRBPIKCNSA-N
InChI
InChI=1S/C40H48O12/c1-34-6-4-22-38(15-48-29(26(34)38)46-13-34)24-20(41)9-17-11-36(24,32(44)50-22)28-19(17)3-8-40(52-28)18-10-21(42)25-37(12-18,31(40)43)33(45)51-23-5-7-35(2)14-47-30-27(35)39(23,25)16-49-30/h17-18,20-27,29-30,41-42H,3-16H2,1-2H3/t17-,18-,20-,21-,22+,23+,24-,25-,26-,27-,29+,30+,34+,35+,36+,37+,38+,39+,40+/m1/s1
Canonical SMILES
CC12CCC3OC(=O)C45CC(CC(O)C4C34COC(OC1)C24)C1(CCC2=C(O1)C13CC2CC(O)C1C12COC4OCC(C)(CCC1OC3=O)C42)C5=O
Isomeric SMILES
C[C@@]12CC[C@H]3[C@]4([C@@H]1[C@@H](OC2)OC4)[C@@H]5[C@@H](C[C@@H]6C[C@]5(C7=C6CC[C@]8(O7)[C@@H]9C[C@H]([C@@H]1[C@@](C9)(C8=O)C(=O)O[C@@H]2[C@@]11CO[C@H]4[C@@H]1[C@@](CC2)(CO4)C)O)C(=O)O3)O

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
720.81 g/molcalc.
Exact mass
720.3146 Dacalc.
LogP (octanol/water)
2.56calc.
Topological polar surface area
156.3 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
12calc.
Rotatable bonds
0calc.
Heavy atoms
52calc.
Rings
13calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.88calc.
Formal charge
0calc.
Stereocentres
19calc.
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=C1OC2CCC3COC4OCC2(C34)C2CCC3CC12C(=O)C31CCC2=C(O1)C13CC2CCC1C12COC4OCC(CCC1OC3=O)C42

O=C1OC2CCC3COC4OCC2(C34)C2CCC3CC12C(=O)C31CCC2=C(O1)C13CC2CCC1C12COC4OCC(CCC1OC3=O)C42

13 rings, 48 atoms.

No other chemical in our database has this scaffold.

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

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

Sculponin D suppliers

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Sculponin D 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 Sculponin D is traded under.

HS 2932.20Indicative HS code

Lactones

World exports in 2024
$1.97B
−4.7% vs 2023, imports $2.07B
2019 to 2024
Top exporters
  1. China56.3%
  2. India * partner reported7.4%
  3. Germany7.3%
Top importers
  1. United States14.2%
  2. India * partner reported13.5%
  3. Brazil8.5%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Sculponin D, based on the data on this page

What is Sculponin D?

UKVLVCQUVUORIL-GRBPIKCNSA-N has been reported in Isodon sculponeatus.

What is the CAS number of Sculponin D?

The CAS registry number of Sculponin D is 1182713-59-2.

What is the molecular formula and weight of Sculponin D?

The molecular formula of Sculponin D is C40H48O12 and its molar mass is 720.81 g/mol.

What is Sculponin D used for?

Known uses and roles of Sculponin D include building blocks in research and laboratory.

Is Sculponin D hazardous?

No GHS hazard classification for Sculponin D is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Sculponin D?

Sculponin D is usually classified under HS code 293220 (Lactones). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Sculponin D?

Post a free request on CompoundList and suppliers of Sculponin D will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Sculponin D?

Suppliers quote Sculponin D 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 Sculponin D

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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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