(Q125617510)

English

(2S)-2-[(1S)-1-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethyl]-5-methyl-2,3-dihydropyran-6-one

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instance of

type of chemical entity

0 references

subclass of

lanostane triterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

454.3446953319999 dalton

1 reference

1 reference

C₃₀H₄₆O₃

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canonical SMILES

O=C1OC(CC=C1C)C(C)C2CCC3(C4=C(CCC23C)C5(C)CCC(O)C(C)(C)C5CC4)C

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isomeric SMILES

CC1=CC[C@@H]([C@@H](C)[C@H]2CC[C@@]3(C)C4=C(CC[C@]23C)[C@@]2(C)CC[C@H](O)C(C)(C)[C@@H]2CC4)OC1=O

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found in taxon

Tomophagus

1 reference

stated in

Highly Modified Lanostane Triterpenes from Fruiting Bodies of the Basidiomycete Tomophagus sp

Identifiers

InChI

InChI=1S/C30H46O3/c1-18-8-10-23(33-26(18)32)19(2)20-12-16-30(7)22-9-11-24-27(3,4)25(31)14-15-28(24,5)21(22)13-17-29(20,30)6/h8,19-20,23-25,31H,9-17H2,1-7H3/t19-,20+,23-,24-,25-,28+,29+,30-/m0/s1

0 references

InChIKey

APHQNJVBNMVFGR-BNAAYKBASA-N

0 references

2 references

26 April 2024

inferred from InChIKey

matched by identifier from

InChIKey

APHQNJVBNMVFGR-BNAAYKBASA-N

(Q125617510)

(2S)-2-[(1S)-1-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethyl]-5-methyl-2,3-dihydropyran-6-one

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Identifiers

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