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Aliphatic and alicyclic building blocks

Cryptoporic acid E

CAS 120001-10-7Formula C45H68O15Molar mass 849.02 g/mol
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Cryptoporic acid E chemical structure, C45H68O15, CAS 120001-10-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
120001-10-7
Formula
C45H68O15
Molar mass
849.02 g/mol
HS code
291899
Category
Aliphatic and alicyclic building blocks

What is Cryptoporic acid E?

Plain description, key identifiers and synonyms

Cryptoporic acid E has been reported in Cryptoporus sinensis, Haploporus odorus, and Cryptoporus volvatus.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(3S,4R)-4-[[(1S,4aR,5R,8aS)-5-[[(2S,3R)-3-[[(1S,4aR,5R,8aS)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methoxy]-2-(carboxymethyl)-4-methoxy-4-oxobutanoyl]oxymethyl]-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methoxy]-5-methoxy-3-methoxycarbonyl-5-oxopentanoic acid
CAS number
120001-10-7
Molecular formula
C45H68O15
UNII
4R12B7J65A
InChIKey
PCFMECNNYYMDRS-VTRNTCPLSA-N
InChI
InChI=1S/C45H68O15/c1-26-12-14-32-42(3,24-46)16-10-18-44(32,5)30(26)22-59-37(41(54)57-9)29(21-35(49)50)39(52)60-25-43(4)17-11-19-45(6)31(27(2)13-15-33(43)45)23-58-36(40(53)56-8)28(20-34(47)48)38(51)55-7/h28-33,36-37,46H,1-2,10-25H2,3-9H3,(H,47,48)(H,49,50)/t28-,29-,30-,31-,32-,33-,36+,37+,42-,43-,44+,45+/m0/s1
Canonical SMILES
C=C1CCC2C(C)(CO)CCCC2(C)C1COC(C(=O)OC)C(CC(=O)O)C(=O)OCC1(C)CCCC2(C)C(COC(C(=O)OC)C(CC(=O)O)C(=O)OC)C(=C)CCC12
Isomeric SMILES
C[C@]1(CCC[C@]2([C@H]1CCC(=C)[C@@H]2CO[C@H]([C@H](CC(=O)O)C(=O)OC[C@@]3(CCC[C@]4([C@H]3CCC(=C)[C@@H]4CO[C@H]([C@H](CC(=O)O)C(=O)OC)C(=O)OC)C)C)C(=O)OC)C)CO

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
849.02 g/molcalc.
Exact mass
848.4558 Dacalc.
LogP (octanol/water)
5.55calc.
Topological polar surface area
218.5 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
13calc.
Rotatable bonds
19calc.
Heavy atoms
60calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.78calc.
Formal charge
0calc.
Stereocentres
12calc.
Lipinski rule of five
Fails (3 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, C=C1CCC2C(COC(=O)CCOCC3C(=C)CCC4CCCCC43)CCCC2C1

C=C1CCC2C(COC(=O)CCOCC3C(=C)CCC4CCCCC43)CCCC2C1

4 rings, 30 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.

Cryptoporic acid E suppliers

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Cryptoporic acid E 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 Cryptoporic acid E is traded under.

HS 2918.99Indicative HS code

Carboxylic acids, with additional oxygen function (not alcohol, phenol, aldehyde or ketone)…

World exports in 2024
$1.46B
−1.1% vs 2023, imports $1.54B
2019 to 2024
Top exporters
  1. China40.0%
  2. India * partner reported26.6%
  3. Germany8.0%
Top importers
  1. United States25.6%
  2. Brazil6.7%
  3. Argentina5.9%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Cryptoporic acid E, based on the data on this page

What is Cryptoporic acid E?

Cryptoporic acid E has been reported in Cryptoporus sinensis, Haploporus odorus, and Cryptoporus volvatus.

What is the CAS number of Cryptoporic acid E?

The CAS registry number of Cryptoporic acid E is 120001-10-7.

What is the molecular formula and weight of Cryptoporic acid E?

The molecular formula of Cryptoporic acid E is C45H68O15 and its molar mass is 849.02 g/mol.

What is Cryptoporic acid E used for?

Known uses and roles of Cryptoporic acid E include building blocks in research and laboratory.

Is Cryptoporic acid E hazardous?

No GHS hazard classification for Cryptoporic acid E 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 Cryptoporic acid E?

Cryptoporic acid E is usually classified under HS code 291899 (Carboxylic acids with additional oxygen function and their anhydrides, halides…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Cryptoporic acid E?

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

What is the price of Cryptoporic acid E?

Suppliers quote Cryptoporic acid E 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 Cryptoporic acid E

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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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