ID: 116404
SMILES:C(C=O)(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.04
InChIKey:STMVZSXJAQXNJN-UHFFFAOYSA-N
ID: 116405
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(C)cc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -19.478
InChIKey:WLKIXSCTQBBZSZ-UHFFFAOYSA-N
ID: 116406
SMILES:Oc1c(CC=C(C)CCC(C(C)=C)=O)c(O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.178
InChIKey:RMCPSPQZPSNJHN-UHFFFAOYSA-N
ID: 116407
SMILES:Cc1c(OC)cc(C2C=C(C)CCC2C(C)=C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.927
InChIKey:STMPGTGTZLHLMR-UHFFFAOYSA-N
ID: 116408
SMILES:Oc1cc2c(cc1CCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.388
InChIKey:LFDBLCTWEXYUKP-UHFFFAOYSA-N
ID: 116409
SMILES:C1(C)CCC2(C(Oc3c(C(C)(CCC=C(C)C)CC)cc(O)cc3O)=O)CC1CC=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.174
InChIKey:QMZYYZHZMQWKCF-UHFFFAOYSA-N
ID: 116410
SMILES:C(c1c(O)cc(CCCCC)cc1O)=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -16.734
InChIKey:BIKKMKWQKFRJNO-UHFFFAOYSA-N
ID: 116411
SMILES:C1(C(C)C)CC2(O)c3c(c(CCCCC)cc(O)c3O)OC(C)(C)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.749
InChIKey:TYZVSEUSPZNBOI-UHFFFAOYSA-N
ID: 116412
SMILES:C(CCC=C(C)CO)(=CCc1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -18.197
InChIKey:ZTNJWVHQBLNABH-UHFFFAOYSA-N
ID: 116413
SMILES:C(OCCc1cc(O)c2c(c1)OC(C)(C)C1C2C(OC2C(O)C(O)C(O)C(CO)O2)C(C)CC1)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.607
CB1 binding score: -15.242
InChIKey:OCNCODFNCQCTBN-UHFFFAOYSA-N
ID: 116414
SMILES:Oc1ccc(-c2cc(O)c(C3C(C(C)=CCC=C(C)C)CCC(C)=C3)c(O)c2C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.576
CB1 binding score: -17.407
InChIKey:KJCUOSXEAMYVJV-UHFFFAOYSA-N
ID: 116415
SMILES:C(c1c2c(ccc1CCCCC)C(C(C)=C)CC2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -16.502
InChIKey:FAMJJUVWILQEDM-UHFFFAOYSA-N
ID: 116416
SMILES:CC1=CC2c3c(cc(CCCC)cc3OC(CCCCCCCC=C)=O)OC2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.239
InChIKey:MORTVIDOYDBGIZ-UHFFFAOYSA-N
ID: 116417
SMILES:CC(=CCc1cc(C2C=C(C)CCC2C(C)=C)c(O)c(Cc2c(=O)oc(CCCC)cc2O)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.776
CB1 binding score: -15.732
InChIKey:AGXVOYWZBOCZIN-UHFFFAOYSA-N
ID: 116418
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.608
InChIKey:FQILBSHXYWCPAM-UHFFFAOYSA-N
ID: 116419
SMILES:C(c1ccc2c(c1)OC(C)(C)C1C2C=C(C)CC1)CC(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.862
InChIKey:KIMVSCBNUNFYRU-UHFFFAOYSA-N
ID: 116420
SMILES:c1(OC(C)=O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -17.994
InChIKey:LCXOAMRAVSWHBP-UHFFFAOYSA-N
ID: 116421
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)C)CCC1(C)O2)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -13.627
InChIKey:OTAGZKICPOJZRR-UHFFFAOYSA-N
ID: 116422
SMILES:C(C1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)Cc1cc(O)ccc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -16.281
InChIKey:NEWITYPGISADRE-UHFFFAOYSA-N
ID: 116423
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CCC12)C(=O)NC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.494
CB1 binding score: -15.243
InChIKey:ZNBGFZDSIHQQOI-UHFFFAOYSA-N
ID: 116424
SMILES:c12c(CCCCC)cc(OC)c(O)c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.378
InChIKey:AWIJOEDLZFMSER-UHFFFAOYSA-N