(Q105176898)

English

(5R,7R,10S,13S,14R,17R)-7-ethoxy-4,4,10,13,14-pentamethyl-17-[(2R,5R,6S)-5,6,7-trihydroxy-6-methylheptan-2-yl]-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

lanostane triterpenoid

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mass

518.397124828 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(5R,7R,10S,13R,14R,17R)-7-ethoxy-4,4,10,13,14-pentamethyl-17-[(2R,5S,6S)-5,6,7-trihydroxy-6-methylheptan-2-yl]-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₂H₅₄O₅

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canonical SMILES

O=C1CCC2(C3=C(C(OCC)CC2C1(C)C)C4(C)CCC(C(C)CCC(O)C(O)(C)CO)C4(C)CC3)C

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isomeric SMILES

CCO[C@@H]1C[C@H]2C(C)(C)C(=O)CC[C@]2(C)C2=C1[C@]1(C)CC[C@H]([C@H](C)CC[C@@H](O)[C@@](C)(O)CO)[C@]1(C)CC2

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found in taxon

Ganoderma lucidum

1 reference

stated in

Novel triterpenoids from the fungus Ganoderma lucidum.

Identifiers

InChI

InChI=1S/C32H54O5/c1-9-37-23-18-24-28(3,4)25(34)14-15-29(24,5)22-13-16-30(6)21(12-17-31(30,7)27(22)23)20(2)10-11-26(35)32(8,36)19-33/h20-21,23-24,26,33,35-36H,9-19H2,1-8H3/t20-,21-,23-,24+,26-,29-,30+,31+,32+/m1/s1

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InChIKey

NBPAZLNDCXUMSM-OTHIEENFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NBPAZLNDCXUMSM-OTHIEENFSA-N

(Q105176898)

(5R,7R,10S,13S,14R,17R)-7-ethoxy-4,4,10,13,14-pentamethyl-17-[(2R,5R,6S)-5,6,7-trihydroxy-6-methylheptan-2-yl]-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one

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Identifiers

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