(Q105310773)

English

(1S,2S,5S,7R,9S,10R,13S)-1,2,9-trimethyl-7-(2-methylprop-1-enyl)-6-oxa-22-azahexacyclo[11.10.0.02,10.05,9.015,23.016,21]tricosa-15(23),16,18,20-tetraene

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1,2,9-Trimethyl-7-(2-methylprop-1-enyl)-6-oxa-22-azahexacyclo[11.10.0.02,10.05,9.015,23.016,21]tricosa-15(23),16,18,20-tetraene

1 reference

based on heuristic

inferred from SMILES

mass

403.287514804 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₇NO

0 references

canonical SMILES

O1C(C=C(C)C)CC2(C)C1CCC3(C)C2CCC4CC=5C=6C=CC=CC6NC5C43C

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isomeric SMILES

CC(C)=C[C@H]1C[C@]2(C)[C@H](CC[C@@]3(C)[C@H]2CC[C@H]2Cc4c([nH]c5ccccc45)[C@@]23C)O1

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found in taxon

Aspergillus flavus

2 references

stated in

Indoloditerpenes from an algicolous isolate of Aspergillus oryzae.

stated in

Indoloditerpenes from an algicolous isolate of Aspergillus oryzae.

Aspergillus cejpii

2 references

stated in

A novel indole-diterpenoid, JBIR-03 with anti-MRSA activity from Dichotomomyces cejpii var. cejpii NBRC 103559.

stated in

Indoloditerpenes from a marine-derived fungal strain of Dichotomomyces cejpii with antagonistic activity at GPR18 and cannabinoid receptors.

Dichotomomyces cejpii

2 references

stated in

A novel indole-diterpenoid, JBIR-03 with anti-MRSA activity from Dichotomomyces cejpii var. cejpii NBRC 103559.

stated in

Indoloditerpenes from a marine-derived fungal strain of Dichotomomyces cejpii with antagonistic activity at GPR18 and cannabinoid receptors.

Fusarium

1 reference

stated in

l-Tryptophan Induces a Marine-Derived Fusarium sp. to Produce Indole Alkaloids with Activity against the Zika Virus

Identifiers

InChI

InChI=1S/C28H37NO/c1-17(2)14-19-16-26(3)23-11-10-18-15-21-20-8-6-7-9-22(20)29-25(21)28(18,5)27(23,4)13-12-24(26)30-19/h6-9,14,18-19,23-24,29H,10-13,15-16H2,1-5H3/t18-,19-,23-,24-,26-,27-,28+/m0/s1

0 references

InChIKey

WQLADPPAYVUSAB-VSUSBFIXSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

ChEBI ID

211319

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C28H37NO/c1-17(2)14-19-16-26(3)23-11-10-18-15-21-20-8-6-7-9-22(20)29-25(21)28(18,5)27(23,4)13-12-24(26)30-19/h6-9,14,18-19,23-24,29H,10-13,15-16H2,1-5H3/t18-,19-,23-,24-,26-,27-,28+/m0/s1

1 reference

Natural Product Atlas ID

NPA014330

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

WQLADPPAYVUSAB-VSUSBFIXSA-N

(Q105310773)

(1S,2S,5S,7R,9S,10R,13S)-1,2,9-trimethyl-7-(2-methylprop-1-enyl)-6-oxa-22-azahexacyclo[11.10.0.02,10.05,9.015,23.016,21]tricosa-15(23),16,18,20-tetraene

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