ID: 99856
SMILES:c12cc(C)cc(O)c1C1C(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.97
InChIKey:QNXGCOZSFWLPLE-UHFFFAOYSA-N
ID: 99857
SMILES:CC1(C)Oc2cc(CCCCC)cc3c2C(C(C)CC3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.664
InChIKey:GSFKAWRHVRITHO-UHFFFAOYSA-N
ID: 99858
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:QPUHYZGLKQWEKI-UHFFFAOYSA-N
ID: 99859
SMILES:CC1(C)CCCC2(c3c(O)cc(CCCC)cc3OC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -14.37
InChIKey:CGHFHSWYZNZCSK-UHFFFAOYSA-N
ID: 99860
SMILES:C1(C)=C2CCC(O)(C)C2C2C(O)(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.075
InChIKey:MBTFQOKMNGPWNK-UHFFFAOYSA-N
ID: 99861
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(O)c3C(=O)C(C)C)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 99862
SMILES:C12(c3c(cc(CCCCC)cc3O)OC1(C)C)OC(C)(C)C1CCC(O)(C)C(CC2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -15.455
InChIKey:SPXQZBGPHQALDZ-UHFFFAOYSA-N
ID: 99863
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1C)OC(C)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.542
InChIKey:LUYZBQKYYOGJGL-UHFFFAOYSA-N
ID: 99864
SMILES:c1(O)c2c(c(CC=C(CO)CCC=C(C=O)C)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -12.258
InChIKey:HHSKIZCWTPDOPU-UHFFFAOYSA-N
ID: 99865
SMILES:OC(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.38
InChIKey:SLZRJWQMWYJIAY-UHFFFAOYSA-N
ID: 99866
SMILES:C(CCc1c2c(ccc1C)OC(C)(C)C1CCC(C)=CC12)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -15.636
InChIKey:BOSTYGHJQIFZHY-UHFFFAOYSA-N
ID: 99867
SMILES:CC(C)=CCC1=C(C)CCC(C(=C)C)C1c1cc(OC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.879
InChIKey:HIWXBYPCSRSWKU-UHFFFAOYSA-N
ID: 99868
SMILES:CC1(C)Oc2c(c(O)ccc2C(C)=O)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.771
InChIKey:MQWTXKCNWTWAHO-UHFFFAOYSA-N
ID: 99869
SMILES:C1(C)CC(C=C(C)C)c2c(O)c(C(O)=O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.792
InChIKey:PTRCRYWPPZHZFI-UHFFFAOYSA-N
ID: 99870
SMILES:C(=O)c1c(O)c2c(cc1CCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -15.753
InChIKey:LYOAILQMZXPVJQ-UHFFFAOYSA-N
ID: 99871
SMILES:c1(O)c2cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.042
InChIKey:SFPKLRGJSVJODS-UHFFFAOYSA-N
ID: 99872
SMILES:CC(=CCCC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 99873
SMILES:CC(C)(CC(O)CC1(C)C=Cc2c(cc3c(c2O)C=CC(C)(CCC=C(C)C)O3)O1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -12.582
InChIKey:OPOOJDNRRBTAPF-UHFFFAOYSA-N
ID: 99874
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)c2c1OC(C)(C)C=C2)CN(C)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 407.554
CB1 binding score: -16.55
InChIKey:DYDSZFRPFMHBJV-UHFFFAOYSA-N
ID: 99875
SMILES:Oc1cc(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: 99876
SMILES:Cc1c(-c2c(CCCCC)cc(O)c(O)c2)c(O)c(C2C=C(CO)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.609
InChIKey:UTIGUKUPMCPPQG-UHFFFAOYSA-N