ID: 127870
SMILES:c1(O)c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 127871
SMILES:C=C(C1Oc2c(c(O)cc(CCCCC)c2)C2C=C(C1)C(=O)OC(C)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -12.959
InChIKey:ZKTWAIYCYFNOKT-UHFFFAOYSA-N
ID: 127872
SMILES:C(C(CC(C)C)=O)C(=CCc1c(O)cc(CCCCC=C(C)C)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.138
InChIKey:YJLSGOWEWAVGFN-UHFFFAOYSA-N
ID: 127873
SMILES:c1(C)c(C2C=C(C)CCC2C(C)=C)c(O)c(Br)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 389.377
CB1 binding score: -12.609
InChIKey:QJCKVZGAXFDVKP-UHFFFAOYSA-N
ID: 127874
SMILES:c1(O)c(CC=C(CCC(O)C(C)=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.454
InChIKey:AXEVFBMIKLHKQY-UHFFFAOYSA-N
ID: 127875
SMILES:C(C)(=O)Oc1cc(C2C=C(C)CCC2C(C)=C)c(O)c(C(=O)CC(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.622
InChIKey:WMCUHJIDAMOKFQ-UHFFFAOYSA-N
ID: 127876
SMILES:c12c(cc(O)c(O)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -20.544
InChIKey:MBKJEOZJMBSFKH-UHFFFAOYSA-N
ID: 127877
SMILES:C1(C(C)(O)C)Oc2c(c(O)cc(CCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.605
InChIKey:METOQGQPKTUCKB-UHFFFAOYSA-N
ID: 127878
SMILES:C1C(C)=CC2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127879
SMILES:O=[N+](c1ccccc1)OC1=C(c2cc3c(cc2)OC(C)(C)C2C3)OC(CCC=C(C)C)(C)C(O)C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.658
CB1 binding score: -15.279
InChIKey:VOPJBIZMDKTBBE-UHFFFAOYSA-N
ID: 127880
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 127881
SMILES:CC[N+](CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -13.304
InChIKey:DSOFADJEHWWYSX-UHFFFAOYSA-N
ID: 127882
SMILES:C12C=C(C)CCC=C(C)CCC1C(C)(C)Oc1c2c(O)cc(C(=O)OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -12.907
InChIKey:VHXYDSFYGBBKJR-UHFFFAOYSA-N
ID: 127883
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(=C(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.314
InChIKey:CTUPXHOEXDMXQS-UHFFFAOYSA-N
ID: 127884
SMILES:C(CCCC=Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.81
InChIKey:HFNXHMAKQGCYQZ-UHFFFAOYSA-N
ID: 127885
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 127886
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127887
SMILES:C(C)C(C)CC(=O)C1C(c2c(C)cc(O)cc2C)OC(C)(C)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.254
InChIKey:GUNXWHSXFKCLMI-UHFFFAOYSA-N
ID: 127888
SMILES:O=C(OC)Cc1cc2c(c(O)c1O)C1C=C(C)CCC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -11.543
InChIKey:XUJAQTPBVIQAIJ-UHFFFAOYSA-N
ID: 127889
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C)(C)C2CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -15.929
InChIKey:NHUOOXCQDLXNBW-UHFFFAOYSA-N
ID: 127890
SMILES:C12C(O)CC3(C)Oc4c(c(O)cc(CCCCC)c4)CC1=C(CO)C(=O)OC23
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.076
InChIKey:NMLGLBPTCRLBSO-UHFFFAOYSA-N