ID: 86920
SMILES:C1=C(C=O)CC(c2c(O)c3c(c(CCCCC)c2)OC(C)(C)CC3)OC1COC(C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -11.773
InChIKey:HINHYOGFTSLTCU-UHFFFAOYSA-N
ID: 86921
SMILES:C1CC(C)(C)C(c2c(O)cc(CCC)cc2OC)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.027
InChIKey:AJTNYZLVYXCCLN-UHFFFAOYSA-N
ID: 86922
SMILES:C1(c2c(O)cc(CCCCCO)cc2O)OC(C(C)(C)O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.417
CB1 binding score: -15.618
InChIKey:GYLAFZDLTVXKJB-UHFFFAOYSA-N
ID: 86923
SMILES:c1c(CC(C)C(O)=O)cc(O)c(C2C=C(C)CCC2C(=C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.146
InChIKey:AYCNIXAXHXSPQC-UHFFFAOYSA-N
ID: 86924
SMILES:C1C(C(C)C)C(c2c(O)cc(O)cc2CCCCC)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.593
InChIKey:RHRYIQNXICLAPT-UHFFFAOYSA-N
ID: 86925
SMILES:O(C)c1c(CC=C(C)CCC=C(C)C)cc(O)c(C2C(C(=C)C)CC=C(C)C2=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -14.638
InChIKey:DJKOCNGXOYOINH-UHFFFAOYSA-N
ID: 86926
SMILES:C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.474
InChIKey:MLOLINWQJGXBEU-UHFFFAOYSA-N
ID: 86927
SMILES:CC1(CCC=C(C)C)C2C(c3c(O)ccc(O)c31)CC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.037
InChIKey:CKLIETMAMNXCST-UHFFFAOYSA-N
ID: 86928
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 86929
SMILES:C(C)CCCc1cc2c(c(O)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 86930
SMILES:COc1c(C)c(=O)c(C(=O)O)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -13.262
InChIKey:GAQMBFBWAWWOPB-UHFFFAOYSA-N
ID: 86931
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(COC(=O)C=Cc2ccc(O)cc2)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -15.786
InChIKey:CLODWVCALRXKJM-UHFFFAOYSA-N
ID: 86932
SMILES:C(Cc1cc2c(c(O)c1COC=O)OC1(C)C2C2C(CC1)C(C)(C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.552
InChIKey:WBPKZAKUDFVPCG-UHFFFAOYSA-N
ID: 86933
SMILES:c1(CCCCCC)cc2c3c(c1O)OC(C)(C)C1C3CC(C)(O2)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.969
InChIKey:QULVKYPNEBHQKL-UHFFFAOYSA-N
ID: 86934
SMILES:c1(C)cc2c3c(c1)OC(COC(=O)C)(C)C3c1c-2c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.586
CB1 binding score: -15.653
InChIKey:BZYQEEVVKMEIOP-UHFFFAOYSA-N
ID: 86935
SMILES:Oc1c2c(cc(CCCCC)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 86936
SMILES:C(O)C12CCCC(=C)C1Cc1c(O)cc(CCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.618
InChIKey:IKKVJUUHGYBBIQ-UHFFFAOYSA-N
ID: 86937
SMILES:c12c(c(CCC(C)(C)OC(=O)C)c(O)cc1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.91
InChIKey:XIXDYKQOLZLNDE-UHFFFAOYSA-N
ID: 86938
SMILES:C1c2c(c(C=O)ccc2C(O)(C)C)Oc2c3c(cc(CCCCC)c21)OC(C)(C)C1C3CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -13.405
InChIKey:UYUVSAJIWSUCPZ-UHFFFAOYSA-N
ID: 86939
SMILES:C1(O)C(O)C(C)CC(C(C)C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -13.239
InChIKey:IPJMGRCISQGVKL-UHFFFAOYSA-N
ID: 86940
SMILES:C(=C)(C1CC(C(=C)C)C(c2c(O)cc(CCCC(O)C)cc2O)C=C1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -13.275
InChIKey:UEKUVVZTSCVBNC-UHFFFAOYSA-N