ID: 98911
SMILES:c1c(Cl)cc(CCCC(C)(CCC2C(C)(C)CCC=C2C)O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.957
CB1 binding score: -12.523
InChIKey:INNYSVMJATWHOE-UHFFFAOYSA-N
ID: 98912
SMILES:C1C(O)C(O)(C)C2C(C3OC2C1O)c1c(O)cc(CCCCC)cc1O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.438
CB1 binding score: -14.678
InChIKey:LVDGUTVUTHJFDJ-UHFFFAOYSA-N
ID: 98913
SMILES:C(c1cc(OC(CC)=O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.202
InChIKey:VPYKJYLKELIWNW-UHFFFAOYSA-N
ID: 98914
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(CO)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.401
InChIKey:IQFBDTWPFXQKNC-UHFFFAOYSA-N
ID: 98915
SMILES:c12c(cc(CCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 98916
SMILES:C(C)CCCc1c(C(=O)O)c(O)c2c(c1)OC1(C)C(C2)C(C)(C)C=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.279
InChIKey:CAVMQJDESUHFBI-UHFFFAOYSA-N
ID: 98917
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 98918
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2=C1CC(O)C(C)=CC=C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -13.387
InChIKey:UNSKFXKXSVSVOO-UHFFFAOYSA-N
ID: 98919
SMILES:CC(=CCOC(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -14.159
InChIKey:BSXPJQVZUYGLMZ-UHFFFAOYSA-N
ID: 98920
SMILES:O=C(C)Oc1cc(C)c(O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.522
InChIKey:PITQHPHVMREBJR-UHFFFAOYSA-N
ID: 98921
SMILES:C1(c2c(O)cc(CCCCC)cc2O)CC(CO)=CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.293
InChIKey:VAHUUHMSLIHMFN-UHFFFAOYSA-N
ID: 98922
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.783
InChIKey:UEGTWXAMWWMYFC-UHFFFAOYSA-N
ID: 98923
SMILES:COc1c(C(CC)C)c(O)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.633
InChIKey:RWIWMWQHDHFCRQ-UHFFFAOYSA-N
ID: 98924
SMILES:C1(c2c(O)cc(CCC)cc2O)CC(C)CCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: -13.061
InChIKey:MJLABADPABWOBB-UHFFFAOYSA-N
ID: 98925
SMILES:C1(CCCC(C)CCO)(C)OC(=O)c2c(CCCCC)cc(O)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.037
InChIKey:RSZLMGFVJACTMQ-UHFFFAOYSA-N
ID: 98926
SMILES:O1C(O)C2=C3C(CCC12)C(C)(C)Oc1cc(CCCCC)cc(O)c13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.63
InChIKey:UXTXFKYBVMSLPS-UHFFFAOYSA-N
ID: 98927
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(OC)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 98928
SMILES:C(C(CC(C)=CCCC(=CCc1c(O)cc(CCCCCCCC)cc1O)C)O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.684
CB1 binding score: -15.906
InChIKey:SMZXGFKXPZGMQT-UHFFFAOYSA-N
ID: 98929
SMILES:C(C)(C)=CCCC1(C)Oc2c(C(=O)C(C)C)c(O)cc(O)c2C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -13.311
InChIKey:MIAOVMGEXZESLN-UHFFFAOYSA-N
ID: 98930
SMILES:CC1(C)C2(C(C)=C(C)CC1)c1c(O)cc(C)cc1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -14.402
InChIKey:SMTRVTQWPPUOSB-UHFFFAOYSA-N
ID: 98931
SMILES:Oc1ccc(CC2C=C(C)CC(c3c(O)c(CC=C(CCC=C(C)C)C)c(O)cc3CCCCCC)c2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.792
CB1 binding score: -17.899
InChIKey:AKDCTDYDZHSARJ-UHFFFAOYSA-N