ID: 52501
SMILES:C1(C)=CCC(CCC(CCCc2ccccc2)C)=C(CC=C(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.546
CB1 binding score: -15.801
InChIKey:OIHFLEXEINBMCM-UHFFFAOYSA-N
ID: 52502
SMILES:C1(C)(C)Oc2c(c(OC)cc(CC(CC=C(C)C)C(=C)C)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.476
InChIKey:FLMMZJZZYWMHSJ-UHFFFAOYSA-N
ID: 52503
SMILES:C1(c2c(O)cc(CCCCC)cc2OC)C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 52504
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 52505
SMILES:Cc1c(O)cc2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.84
InChIKey:LEMHOGCTMPDYOF-UHFFFAOYSA-N
ID: 52506
SMILES:c1(-c2ccc(O)cc2)cc(O)c2c(c1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.457
CB1 binding score: -11.599
InChIKey:OIEKQYBNXVXLGX-UHFFFAOYSA-N
ID: 52507
SMILES:C12=C(C)C(=O)CC1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.972
InChIKey:XHFHDAVBENMYIX-UHFFFAOYSA-N
ID: 52508
SMILES:c1c(CCCCCC)cc(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 52509
SMILES:c12c(c(O)c(OC)c(CC=C)c1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.191
InChIKey:HPXKHWGXMJNWLI-UHFFFAOYSA-N
ID: 52510
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 52511
SMILES:c1c(-c2cc(CC=C)c(O)cc2)c2c(cc1O)OC(C)(C)C1C2C=C(CCC=C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.615
CB1 binding score: -18.085
InChIKey:FOHDQTHRKHKMJJ-UHFFFAOYSA-N
ID: 52512
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.196
InChIKey:HQWTZGLRGCSGTB-UHFFFAOYSA-N
ID: 52513
SMILES:C(C=CCC=CCCCCCCCC(OCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(COC(=O)Cc3cc(OC)c(O)c(OC)c3)CC21)=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 718.928
CB1 binding score: -15.482
InChIKey:PXLHNOLXQRVUSA-UHFFFAOYSA-N
ID: 52514
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)OC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.312
InChIKey:CNXREHVLDPHJFK-UHFFFAOYSA-N
ID: 52515
SMILES:C=C(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 52516
SMILES:c1(CCCCC)cc2c(c(O)c1COC(=O)CC(C)C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -11.843
InChIKey:UDXCWRRAHLKVAO-UHFFFAOYSA-N
ID: 52517
SMILES:C12(C(C)(C)OC(=O)C=C1)C(C)=CC1CC(C)(CC)CC1=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.143
InChIKey:ICKRCRONZUKVRK-UHFFFAOYSA-N
ID: 52518
SMILES:C(CCc1cc(O)c(C2CC(C)(O)CCC2C(C)C)cc1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.582
CB1 binding score: -11.175
InChIKey:PJFBOTVPIOASGK-UHFFFAOYSA-N
ID: 52519
SMILES:C1(C)=CC2C(CC1O)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 52520
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)c(C(=O)CC(C)C)c(O)c(C=O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 372.461
CB1 binding score: -17.581
InChIKey:JFADHCMLMYPJCV-UHFFFAOYSA-N
ID: 52521
SMILES:O=C1CC2(c3c(cc(CCC(C=CC(C)(C)O)=O)cc3O)O2)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -15.526
InChIKey:PECBEHQEOQUYDA-UHFFFAOYSA-N