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(Q77513999)
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English
13-oxofumitremorgin B
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
1-Hydroxy-7-methoxy-10-(3-methylbut-2-enyl)-12-(2-methylprop-1-enyl)-10,13,19-triazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-3(11),4(9),5,7-tetraene-2,14,20-trione
1 reference
based on heuristic
inferred from SMILES
mass
477.226371092
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
5a-Hydroxy-9-methoxy-11-(3-methyl-2-butenyl)-12-(2-methyl-1-propenyl)-2,3,11,12-tetrahydro-1H,5H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole-5,6,14(5aH,14aH)-trione
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₇H₃₁N₃O₅
0 references
canonical SMILES
O=C1C=2C=3C=CC(OC)=CC3N(C2C(C=C(C)C)N4C(=O)C5N(C(=O)C14O)CCC5)CC=C(C)C
0 references
isomeric SMILES
COc1ccc2c3c(n(CC=C(C)C)c2c1)[C@H](C=C(C)C)N1C(=O)[C@@H]2CCCN2C(=O)[C@]1(O)C3=O
0 references
found in taxon
Sordaria goundaensis
1 reference
stated in
Immunosuppressive constituents from an Ascomycete, Sordaria gondaensis
Identifiers
InChI
InChI=1S/C27H31N3O5/c1-15(2)10-12-28-20-14-17(35-5)8-9-18(20)22-23(28)21(13-16(3)4)30-25(32)19-7-6-11-29(19)26(33)27(30,34)24(22)31/h8-10,13-14,19,21,34H,6-7,11-12H2,1-5H3/t19-,21-,27+/m0/s1
0 references
InChIKey
PKXCLEPXRNTYPU-BKCZMFJTSA-N
2 references
stated in
PubChem
PubChem CID
102583557
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
102583557
language of work or name
English
PubChem CID
102583557
1 reference
stated in
PubChem
PubChem CID
102583557
language of work or name
English
UniChem compound ID
97029396
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA013241
1 reference
based on heuristic
inferred from InChIKey
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