ID: 96895
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.69
InChIKey:VZITYWYBMUXCLP-UHFFFAOYSA-N
ID: 96896
SMILES:CC(C)=CCCC(=CCc1c(O)cc(CCC)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.187
InChIKey:ZKXZJUZIDUHJLH-UHFFFAOYSA-N
ID: 96897
SMILES:c1c2c(cc(CCCC)c1O)C(=O)OC(C)(C)C1CCC(O)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.508
InChIKey:SCIVYLRNIPSRGU-UHFFFAOYSA-N
ID: 96898
SMILES:Oc1c(CC=C(C)CCC2C(C)(C)O2)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.277
InChIKey:NIAKGXQZMJRCGK-UHFFFAOYSA-N
ID: 96899
SMILES:C1CCC(C)(C)C(Cc2c(OC)c(CCCCC)cc(OC)c2)=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -15.12
InChIKey:BGKVDWLRRHQYAY-UHFFFAOYSA-N
ID: 96900
SMILES:C1(C)=C2C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.676
InChIKey:LREHDWGBWFUSKI-UHFFFAOYSA-N
ID: 96901
SMILES:C1=C(C=O)CCC(C(C)=C)C1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.621
InChIKey:DZKYZHQLFVXYGV-UHFFFAOYSA-N
ID: 96902
SMILES:c1(O)cc2c(cc1C)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.07
InChIKey:JAQQPODSAWTCBC-UHFFFAOYSA-N
ID: 96903
SMILES:C1(CO)=CC2C(CC1)C(C)(C)Oc1c-2cc(O)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.234
InChIKey:LJMYLOQUVDAJRW-UHFFFAOYSA-N
ID: 96904
SMILES:O=C1C(=C(C)C)C(=O)C(O)(c2c(O)cc(CCCCC)cc2O)C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.508
InChIKey:IHEPXWYAFSVJJV-UHFFFAOYSA-N
ID: 96905
SMILES:CC1=CC(c2c(O)c(C(=O)C=C(C)CCC=C(C)C)cc(C(O)=O)c2O)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -15.944
InChIKey:LRGMXOAAFXDXLS-UHFFFAOYSA-N
ID: 96906
SMILES:C1(OC(C)=O)C(C)(O)CC2C(C(=C)COc3cc(CCCCCCCO)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -14.125
InChIKey:CAMYAEWMNDQKMJ-UHFFFAOYSA-N
ID: 96907
SMILES:CC1(C)C(CCC(C)=CCc2c(O)c(C(=O)O)c(CCC)cc2O)=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.477
InChIKey:GBOAFELGBJETOA-UHFFFAOYSA-N
ID: 96908
SMILES:C1C2(C)C(O)C3c4c(O)cc(CCCCC)cc4OC3(C)CC2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.56
InChIKey:AFXZFOCZBGOIAP-UHFFFAOYSA-N
ID: 96909
SMILES:C=C(C)C12OCC(Cc3c(OC(C)=O)cc(CCCCC)cc3O1)=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.956
InChIKey:JXQPQVPEAYCOTR-UHFFFAOYSA-N
ID: 96910
SMILES:C1(C(C)C)C(c2c(O)cc(CCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.334
InChIKey:UOQAQJLARPRUBJ-UHFFFAOYSA-N
ID: 96911
SMILES:C(C(CC)C)Cc1cc2c(c(O)c1)C1C(C(C)(CCC=C(C)C)O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.062
InChIKey:BFIFVGWQVNVFCM-UHFFFAOYSA-N
ID: 96912
SMILES:C(O)C(=C)C1CCC(C)(O)C2Oc3c(c(O)cc(CCCCCC)c3)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.875
InChIKey:YLLRDHJNCDSJHF-UHFFFAOYSA-N
ID: 96913
SMILES:C(C)(C1=CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.618
InChIKey:COMBRZRRYZPRNH-UHFFFAOYSA-N
ID: 96914
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(C(=O)OC)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.882
InChIKey:PZGQMCZVNQZFFP-UHFFFAOYSA-N
ID: 96915
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC=C(C=O)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.255
InChIKey:BGIBNWZALWRTHR-UHFFFAOYSA-N