ID: 57457
SMILES:c12c(C(=CC(C)C)OC)cc(C)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -14.605
InChIKey:SDNQAEVCXVLWON-UHFFFAOYSA-N
ID: 57458
SMILES:C1(C)=CCC(C)(C)C=CCC2(C)Oc3c(c(O)c(C(=O)OC)c(CCCCC)c3)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -14.727
InChIKey:SFAHMZNOUHBLBS-UHFFFAOYSA-N
ID: 57459
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=C2C2C(C)(O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.015
InChIKey:HESNUMLBEXPOKA-UHFFFAOYSA-N
ID: 57460
SMILES:C1(OC)=C(C(C)CC)C(=O)C2=C(OC(C)(C)C3C2CC(C)=CC3)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.129
InChIKey:ZJLFREURIGWRED-UHFFFAOYSA-N
ID: 57461
SMILES:c1(CC2C(C)(C)OC(=O)C2)c(C)cc2c(c1)C(C)(CCCC(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 344.495
CB1 binding score: -15.454
InChIKey:CQFWSCMBVHPJIE-UHFFFAOYSA-N
ID: 57462
SMILES:C(OC1CC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C)(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -18.014
InChIKey:UPGHLBTWHYRBNS-UHFFFAOYSA-N
ID: 57463
SMILES:c1(C)c(C)c(C)c2c(c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -15.9
InChIKey:TWPCCGJZYGSOON-UHFFFAOYSA-N
ID: 57464
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 57465
SMILES:CC1(C)CCCC2(C)Oc3c(c(O)c(C(=O)OC)c(CCCCC)c3)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.506
InChIKey:GOOUMTZYAFBPGQ-UHFFFAOYSA-N
ID: 57466
SMILES:c1(CC=C(C)C)c2c(cc(C)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -16.42
InChIKey:UWNUTAHOQMKTCZ-UHFFFAOYSA-N
ID: 57467
SMILES:c12c(ccc(CCCCC)c1)OC(C(C)(O)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -17.951
InChIKey:QBJJHVAFGNJSIZ-UHFFFAOYSA-N
ID: 57468
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)C)c(OC)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.187
InChIKey:ZKXZJUZIDUHJLH-UHFFFAOYSA-N
ID: 57469
SMILES:C1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1(C)CCC1(C)C2(O)CC(C)(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.9
InChIKey:VTSOHFHZEWUJDC-UHFFFAOYSA-N
ID: 57470
SMILES:C(Cc1c(O)cc(O)c2c3c(ccc12)OC(C)(C)C1CCC(C)=CC31)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -14.419
InChIKey:VGALQDIDNFYWDM-UHFFFAOYSA-N
ID: 57471
SMILES:C1C(C)=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 57472
SMILES:c1(OC)c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.277
InChIKey:WJABVLUXMBMMIO-UHFFFAOYSA-N
ID: 57473
SMILES:CC(=CCc1c(O)c(C2C(C(O)(C)C)CCC(C)=C2)c(O)cc1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.315
InChIKey:JDVCVCKWUYHZIL-UHFFFAOYSA-N
ID: 57474
SMILES:C(C)=C(O)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -14.648
InChIKey:XIWGFFFHAOTEPN-UHFFFAOYSA-N
ID: 57475
SMILES:C1CC2(c3c(O)cc(CCCCC)cc31)C(=C)CC(O)C(O)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -10.458
InChIKey:WZFZIYPNORLVMH-UHFFFAOYSA-N
ID: 57476
SMILES:C(O)(C(CC1(c2cc(OC)cc(CCCCC)c2)OC(C)(C)C(O)C1)C)OC(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.562
CB1 binding score: -14.231
InChIKey:JMCGBOCDEUEAMH-UHFFFAOYSA-N
ID: 57477
SMILES:C(C)(CC)C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)CC21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.105
InChIKey:ZRMLSFHYUQTPPJ-UHFFFAOYSA-N