(Q105209720)

English

(2R,3R,4S,5S,6R)-2-[[(1S,2R,5R,6R,10R,13S,15S)-5-[(E,2R,5S)-5,6-dimethylhept-3-en-2-yl]-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadeca-8,18-dien-13-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2-[[5-(5,6-Dimethylhept-3-en-2-yl)-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadeca-8,18-dien-13-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

588.366218624 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(22E,24R)-5alpha,8alpha-epidioxyergosta-6,9,22-triene-3beta-ol-3-O-beta-D-glucopyranoside

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₄H₅₂O₈

0 references

canonical SMILES

OCC1OC(OC2CCC3(C4=CCC5(C)C(CCC5C64OOC3(C=C6)C2)C(C=CC(C)C(C)C)C)C)C(O)C(O)C1O

0 references

isomeric SMILES

CC(C)[C@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@]34C=C[C@]5(C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)C3=CC[C@]12C)OO4

0 references

found in taxon

Tricholoma saponaceum

1 reference

stated in

New Triterpenoids from Tricholoma saponaceum

Identifiers

InChI

InChI=1S/C34H52O8/c1-19(2)20(3)7-8-21(4)23-9-10-25-31(23,5)13-12-26-32(6)14-11-22(17-33(32)15-16-34(25,26)42-41-33)39-30-29(38)28(37)27(36)24(18-35)40-30/h7-8,12,15-16,19-25,27-30,35-38H,9-11,13-14,17-18H2,1-6H3/b8-7+/t20-,21-,22+,23-,24-,25-,27-,28+,29-,30-,31-,32-,33-,34+/m1/s1

0 references

InChIKey

PIUDVAYSOWOHCO-KXYKKNSRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PIUDVAYSOWOHCO-KXYKKNSRSA-N

(Q105209720)

(2R,3R,4S,5S,6R)-2-[[(1S,2R,5R,6R,10R,13S,15S)-5-[(E,2R,5S)-5,6-dimethylhept-3-en-2-yl]-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadeca-8,18-dien-13-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Statements

Identifiers

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