ID: 99037
SMILES:C(C)CCCc1cc(O)c(C2C=C(C(O)CC=C(CO)CCC=C(C)C)CO2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.265
InChIKey:BUYDGZVGCOEOLK-UHFFFAOYSA-N
ID: 99038
SMILES:CC(C)=CC(=O)CC(C1C2c3c(cc(CCCCC)cc3O)OC(C)(CC1)C=C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.29
InChIKey:MDGOMLIXCIGCSG-UHFFFAOYSA-N
ID: 99039
SMILES:C(CCC)Cc1cc2c(c(O)c1)OC1(C)C(C2)C(C)(C)C2CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.995
InChIKey:HSYBJUZBPJIAIG-UHFFFAOYSA-N
ID: 99040
SMILES:C12(C)Oc3c(c(OC)cc(CCCCC)c3)C3CC1C(CC2)C3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -11.834
InChIKey:STUDLAPLYCYEQC-UHFFFAOYSA-N
ID: 99041
SMILES:C1(O)C2C(C(C)(C)Oc3cc(CCCCCCCCCC)c(C(C)=O)c(O)c31)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -14.435
InChIKey:NMJGLXZPIGXWEB-UHFFFAOYSA-N
ID: 99042
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(C)(C)O2)CCC(C(=O)O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 99043
SMILES:c1(C(CC(C2=C(C)CCCC2(C)C)O)OC(=O)C)c(O)c(C)cc2c1C(C)CO2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.574
InChIKey:GIGVMUJNZARVBR-UHFFFAOYSA-N
ID: 99044
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2)C=C(C(O)=O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.934
InChIKey:MOOYPCCXSOBOTR-UHFFFAOYSA-N
ID: 99045
SMILES:CC1(C)C(CCC2(C)Oc3cc(C)cc(O)c3C=C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -19.337
InChIKey:CPBHEJIKHIHMDY-UHFFFAOYSA-N
ID: 99046
SMILES:C12(C(C=CC(C)(O)C)(C)C(=O)CCC1C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.489
InChIKey:ZPEUHSBXRUCKPN-UHFFFAOYSA-N
ID: 99047
SMILES:C1C=C(C=O)CCC2C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.446
InChIKey:JWBNRQFKVWTPSU-UHFFFAOYSA-N
ID: 99048
SMILES:CC1(C)C2C(C(C)C(=O)C2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -19.158
InChIKey:UVSUMQHBUPOPKC-UHFFFAOYSA-N
ID: 99049
SMILES:O=c1c(C)cc2c3c(c1)OC(C)(C)C1CCC(C)C(C31)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.091
InChIKey:HYTILDAORAGTTH-UHFFFAOYSA-N
ID: 99050
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2OC)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 99051
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(COC(CC(C)(C)O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.397
InChIKey:XAFIYWOYRVDCMK-UHFFFAOYSA-N
ID: 99052
SMILES:O=C1c2c(cc(CCCC)cc2O)OC(C)(C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.305
CB1 binding score: -16.659
InChIKey:MDCSDJJRJYAUEO-UHFFFAOYSA-N
ID: 99053
SMILES:O1C(CC2(C)OC(C)(C)C(O)C(O)C2)CC(C)=CC=CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.461
CB1 binding score: -16.272
InChIKey:YTQZFMLXTJUQEB-UHFFFAOYSA-N
ID: 99054
SMILES:CCCCCc1cc(O)c2cc1C1(CCC(C(C)=C)C(CCC(O)=O)(C)O1)C(=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.67
InChIKey:QUGFIGDGVVIEEF-UHFFFAOYSA-N
ID: 99055
SMILES:Cc1cc(O)c(CC=C(CCC=C(C)CC2C(C(C)=C)O2)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.521
InChIKey:DSTLKXIHNVSFPR-UHFFFAOYSA-N
ID: 99056
SMILES:C1(CO)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 99057
SMILES:c1(O)c(C(=O)O)c(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N