ID: 125476
SMILES:CCCCc1c(C=O)c2c(c(O)c1)C1C(C(C)(CO)O2)C(C(=C)C)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.327
InChIKey:DXBZDFKTGJDFKA-UHFFFAOYSA-N
ID: 125477
SMILES:c1c2c(ccc1C)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 125478
SMILES:C(CCc1cc2c(c(O)c1)C1CC(O)(C)CCC3C(C)(C)CC1(C(=O)O2)OC3)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.368
InChIKey:NMAOMTFNQXLQDP-UHFFFAOYSA-N
ID: 125479
SMILES:c1cc(COc2c(CC=C(C)C)c(O)cc(CCCCCC)c2)ccc1CCC
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 394.599
CB1 binding score: -14.605
InChIKey:FFKMMDRWXHBYFO-UHFFFAOYSA-N
ID: 125480
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.955
InChIKey:UKTDGUHOBZBFHV-UHFFFAOYSA-N
ID: 125481
SMILES:C(C=C(CC(C=C(C)C)=O)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 330.468
CB1 binding score: -17.947
InChIKey:ZXDVFJZNEMZQLZ-UHFFFAOYSA-N
ID: 125482
SMILES:c1cc(-c2c(O)c3c(cc2CCCCC)OC(C)(C)C(O)CC3)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -17.254
InChIKey:PUNMLEFIVYAXGQ-UHFFFAOYSA-N
ID: 125483
SMILES:c12c(cc(CCCCC)cc1OC)OC(C)(C)C1C2C(C(C)=O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.672
InChIKey:PJIBPBOAHBQSQI-UHFFFAOYSA-N
ID: 125484
SMILES:C1(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 125485
SMILES:c1c(CCCCC)c(C(=O)O)c(O)c2c1C1C(C(C)(C)O2)CC(=O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.401
InChIKey:IOXQTYZVKHBDQO-UHFFFAOYSA-N
ID: 125486
SMILES:C(N(C)CC(=O)O)c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 391.464
CB1 binding score: -15.524
InChIKey:ZYYTYXABXJEZBQ-UHFFFAOYSA-N
ID: 125487
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.655
InChIKey:SZHRAJIVTRNORX-UHFFFAOYSA-N
ID: 125488
SMILES:C12C(C)(CCCC1(C)C)Oc1cc(CCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 288.431
CB1 binding score: -18.4
InChIKey:IYJFZOBKCYBWAD-UHFFFAOYSA-N
ID: 125489
SMILES:C=C(C)C(CCC(C)=CCc1c(O)cc(CCCCC)cc1O)OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.706
InChIKey:GTHVCFLKWJJJTL-UHFFFAOYSA-N
ID: 125490
SMILES:c1(O)c(C2C(C(C)=CCCC=C(C)C)CC(OC(=O)C)C(C)=C2)cc(OC2OC(CO)C(O)C(O)C2O)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.684
CB1 binding score: -13.362
InChIKey:VVWRBCRYBJPYQF-UHFFFAOYSA-N
ID: 125491
SMILES:c12c(O)cc(CCC(=O)O)cc1OC1C2(C)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -16.243
InChIKey:CZXSUYRAQZBVDZ-UHFFFAOYSA-N
ID: 125492
SMILES:C(C)(C)C1CCC(C)C=C1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.147
InChIKey:DPUDWYIUBWCWTK-UHFFFAOYSA-N
ID: 125493
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 125494
SMILES:c1(N=C(C=C)O)ccc(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.397
CB1 binding score: -12.529
InChIKey:GRZAOHMTAVAGAE-UHFFFAOYSA-N
ID: 125495
SMILES:C12C(CC(C)C(O)C1)c1c(cc(CCCCCC)cc1O)OC(C)(C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -14.958
InChIKey:XVKBIOHBNAIWJH-UHFFFAOYSA-N
ID: 125496
SMILES:C12(CCCC(C)C)c3c(cc(O)cc3O)C(=O)OC(C)(C)C1CC=C(C)CC2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.031
InChIKey:ZAOQQIOSBVUILR-UHFFFAOYSA-N