(Q77508970)

English

Roridin L

bioactive natural product

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Statements

instance of

type of chemical entity

0 references

subclass of

(18'E)-27'-hydroxy-17'-(1-hydroxyethyl)-5',13',25'-trimethyl-2',10',16',23'-tetraoxaspiro[oxirane-2,26'-tetracyclo[22.2.1.0³,⁸.0⁸,²⁵]heptacosane]-4',12',18',20'-tetraene-11',22'-dione

1 reference

based on heuristic

inferred from SMILES

27-Hydroxy-17-(1-hydroxyethyl)-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione

1 reference

1 reference

530.251582796 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₈O₉

0 references

canonical SMILES

O=C1OCC23CCC(=CC3OC4C(O)C(OC(=O)C=CC=CC(OCCC(=C1)C)C(O)C)C2(C)C54OC5)C

0 references

isomeric SMILES

CC1=CC(=O)OCC23CCC(C)=CC2OC2C(O)C(OC(=O)/C=C/C=CC(C(C)O)OCC1)C3(C)C21CO1

1 reference

based on heuristic

inferred from InChI

found in taxon

Albifimbria verrucaria

1 reference

stated in

Roridin L, M and verrucarin M, new macrocyclic trichothecene group antitumor antibiotics, from Myrothecium verrucaria

Myrothecium verrucaria

1 reference

stated in

Roridin L, M and verrucarin M, new macrocyclic trichothecene group antitumor antibiotics, from Myrothecium verrucaria

Identifiers

InChI

InChI=1S/C29H38O9/c1-17-9-11-28-15-35-23(32)14-18(2)10-12-34-20(19(3)30)7-5-6-8-22(31)38-25-24(33)26(37-21(28)13-17)29(16-36-29)27(25,28)4/h5-8,13-14,19-21,24-26,30,33H,9-12,15-16H2,1-4H3/b7-5?,8-6+,18-14?

0 references

InChIKey

CXUYRNDRKDXIHC-NWIKPKNNSA-N

2 references

language of work or name

English

stated in

Natural Product Atlas

PubChem CID

139586559

language of work or name

2 references

language of work or name

English

matched by identifier from

InChIKey

CXUYRNDRKDXIHC-NWIKPKNNSA-N

ChEBI ID

224426

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C29H38O9/c1-17-9-11-28-15-35-23(32)14-18(2)10-12-34-20(19(3)30)7-5-6-8-22(31)38-25-24(33)26(37-21(28)13-17)29(16-36-29)27(25,28)4/h5-8,13-14,19-21,24-26,30,33H,9-12,15-16H2,1-4H3/b7-5?,8-6+,18-14?

1 reference

Natural Product Atlas ID

NPA012443

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

CXUYRNDRKDXIHC-NWIKPKNNSA-N

(Q77508970)

Roridin L

Statements

Identifiers

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