(Q104199648)

English

5-[[17-(5,6-dihydroxy-6-methylheptan-2-yl)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-2-yl]oxy]-3-hydroxy-3-methyl-5-oxopentanoic acid

group of stereoisomers with the chemical formula C₃₆H₆₀O₈

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Statements

instance of

group of stereoisomers

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subclass of

lanostane triterpenoid

1 reference

inferred from

lanostane triterpenoid

mass

620.42881888 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₆₀O₈

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canonical SMILES

O=C(O)CC(O)(C)CC(=O)OC1CC2(C3=C(CCC2C(C)(C)C1O)C4(C)CCC(C(C)CCC(O)C(O)(C)C)C4(C)CC3)C

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found in taxon

Hypholoma

1 reference

stated in

Fasciculic acids A, B and C as calmodulin antagonists from the mushroom Naematoloma fasciculare

Psilocybe

1 reference

stated in

Fasciculic acids A, B and C as calmodulin antagonists from the mushroom Naematoloma fasciculare

Identifiers

InChI

InChI=1S/C36H60O8/c1-21(10-13-27(37)32(4,5)42)22-14-16-36(9)24-11-12-26-31(2,3)30(41)25(44-29(40)20-33(6,43)19-28(38)39)18-34(26,7)23(24)15-17-35(22,36)8/h21-22,25-27,30,37,41-43H,10-20H2,1-9H3,(H,38,39)

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InChIKey

VOAJMYUEWCGJID-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

VOAJMYUEWCGJID-UHFFFAOYSA-N

1 reference

Human Metabolome Database ID

HMDB0036439

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

VOAJMYUEWCGJID-UHFFFAOYSA-N

(Q104199648)

5-[[17-(5,6-dihydroxy-6-methylheptan-2-yl)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-2-yl]oxy]-3-hydroxy-3-methyl-5-oxopentanoic acid

Statements

Identifiers

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