ID: 112330
SMILES:C1(C(O)(C)C)CC(C(C)=C)CC(c2cc(CCCCC)cc(O)c2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.626
InChIKey:DKRXFEHUJVBQPA-UHFFFAOYSA-N
ID: 112331
SMILES:C1C2C(C(C)(C)Oc3c1c(O)cc(C)c3)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -15.581
InChIKey:NYBPCKMLTBWWQG-UHFFFAOYSA-N
ID: 112332
SMILES:C(CC)CCc1cc(O)c(C2C(O)C(C)=CCC2C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.468
InChIKey:GPRDDZSMIQCDPI-UHFFFAOYSA-N
ID: 112333
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.423
InChIKey:MRLLOLSGDYQJHB-UHFFFAOYSA-N
ID: 112334
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)CC1)C(C)=CC=CC(C)=CC=CC=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.985
InChIKey:LPJRUSYSWFOQMK-UHFFFAOYSA-N
ID: 112335
SMILES:C(C(=C)C)(CCC(C)=CCOc1cc(CCCCC)cc(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.504
InChIKey:PHIULMLZQCVJAY-UHFFFAOYSA-N
ID: 112336
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)c2c(c1)CC1C(C(=C)CO)CCC1(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -17.748
InChIKey:GSDWXYRGIFKIJJ-UHFFFAOYSA-N
ID: 112337
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -17.334
InChIKey:BZOYWIKHOMJWTI-UHFFFAOYSA-N
ID: 112338
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 112339
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2CC(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.046
InChIKey:UECUNLJHUBNWSC-UHFFFAOYSA-N
ID: 112340
SMILES:O1c2c(c(O)cc(C)c2)C(C)C1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.774
InChIKey:NQQJCDOUMQUYST-UHFFFAOYSA-N
ID: 112341
SMILES:O(C(C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: Not available
InChIKey:BVTYWKWCPBGHFC-UHFFFAOYSA-N
ID: 112342
SMILES:CC(C)(c1cc(O)c2c(c1)C1C(CC=C(C)C1)C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -7.591
InChIKey:YTUROWWXOCAFID-UHFFFAOYSA-N
ID: 112343
SMILES:C1(O)C2(C)CCC(C(C)C)C(c3c(O)cc(CCCCC)cc3O)C2C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -15.465
InChIKey:DYMABROTSFTJIB-UHFFFAOYSA-N
ID: 112344
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: 112345
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 112346
SMILES:c1(C)cc(O)c2c(c1)OC1(C)CCC(C(C)C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.982
InChIKey:LLJLKFGCUWOEGS-UHFFFAOYSA-N
ID: 112347
SMILES:C1=C(C)CC2c3c(ccc(CCCCC)c3)OC(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.459
InChIKey:BFVZGBZDELJDHT-UHFFFAOYSA-N
ID: 112348
SMILES:c1c(OC)cc2c(c1)C1=CC(C)(C)OC(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.349
InChIKey:AMXRNCRRFNYRNG-UHFFFAOYSA-N
ID: 112349
SMILES:O(c1c(OC)cc(-c2cc(O)c(C3C=C(C)CCC3C(C)=C)c(O)c2)o1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -14.956
InChIKey:NKGUEDPFIWRNPL-UHFFFAOYSA-N
ID: 112350
SMILES:C1C2C(C)(c3c(O)cc(CCCCC)cc3OC2(C)C)C(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.563
InChIKey:CRHVLIZYZCVHHL-UHFFFAOYSA-N