ID: 115816
SMILES:C1(c2cc(O)c3c(c2)OC(C)(C)C2C3C(O)C(C)C(O)C2)C(C=C(C)C)(Oc2c(O)cc(CCCCC)cc2O)CC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 622.843
CB1 binding score: -13.452
InChIKey:KDEUFXLHZVRINO-UHFFFAOYSA-N
ID: 115817
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -16.173
InChIKey:HGAAYWBASODVBC-UHFFFAOYSA-N
ID: 115818
SMILES:O1C2(C)C(=O)CC3C(C)(C)Oc4c(C(C=C)(C)C)cc(O)cc4C(=O)C3C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -12.268
InChIKey:IZFNGKHFBXXYIY-UHFFFAOYSA-N
ID: 115819
SMILES:CC(OC1CC(O)(C)C2C(C3C1c1c(cc(CCC)cc1O)OC3(C)C)C2=O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -14.878
InChIKey:JTBZQEWQRVTYBW-UHFFFAOYSA-N
ID: 115820
SMILES:c1(=O)c2occc2cc(C2CC(C)=CC(c3c(O)cc(CCCCC)cc3OC)C2C(C)=C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.586
CB1 binding score: -15.916
InChIKey:ZKBLKRNGUTZZAI-UHFFFAOYSA-N
ID: 115821
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.898
InChIKey:SUVXTOCRTNYFMQ-UHFFFAOYSA-N
ID: 115822
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O1)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.69
InChIKey:VZITYWYBMUXCLP-UHFFFAOYSA-N
ID: 115823
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2)C(C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 272.432
CB1 binding score: -19.328
InChIKey:YHUODCAWVDJHGS-UHFFFAOYSA-N
ID: 115824
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 115825
SMILES:CC1(C)Oc2c(c(O)c(OC)c(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.277
InChIKey:WJABVLUXMBMMIO-UHFFFAOYSA-N
ID: 115826
SMILES:CC(CC(O)=O)=CCC1C(C)(C)C2Oc3cc(C)cc(O)c3C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: Not available
InChIKey:KZWSAVHTNFLYBX-UHFFFAOYSA-N
ID: 115827
SMILES:C12C(C(C)(C)Oc3cc(CCC)cc(O)c31)CCC(C)=CCCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -19.615
InChIKey:UPPMRXFTGBOGTA-UHFFFAOYSA-N
ID: 115828
SMILES:C(C)(O)(C(O)CCC(=CCCC(C)(C=C)Oc1cc(CCCCC)cc2c1C=CC(C)(C)O2)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -11.206
InChIKey:ZPFWAPXMQXNQEW-UHFFFAOYSA-N
ID: 115829
SMILES:c1c(N)cc(C2C=C(C)CCC2C(C)=C)c(O)c1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 311.469
CB1 binding score: -16.809
InChIKey:XVAPEKOXYSLKGF-UHFFFAOYSA-N
ID: 115830
SMILES:O1c2cc(C)cc(O)c2C2C1C(C)(O)CCC2C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.646
InChIKey:JUEQMXVOZPWLKJ-UHFFFAOYSA-N
ID: 115831
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C(C)=C)C(C=C(C)C)CC1(C)CC2CC(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.708
CB1 binding score: -15.509
InChIKey:GXMFYNGRYJCCNG-UHFFFAOYSA-N
ID: 115832
SMILES:C1(=C)C2CCC(C)=C3C24C(C(C)(Oc2cc(CCCCC)cc(O)c24)O3)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -13.968
InChIKey:RXJIPCAPEYWSKZ-UHFFFAOYSA-N
ID: 115833
SMILES:C12CC3OC3(C)C1C(C=C(C)C)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.434
InChIKey:LFKLUUNPERSQEG-UHFFFAOYSA-N
ID: 115834
SMILES:C(CCCC)c1cc(O)cc(CC=C(C)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.367
CB1 binding score: -17.843
InChIKey:OBEVZLNBDCMTNW-UHFFFAOYSA-N
ID: 115835
SMILES:c1(O)c(C)cc2c(c1)C1C(C(C)(C)O2)CCC(=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.065
InChIKey:SELBXHQOJCXJSE-UHFFFAOYSA-N
ID: 115836
SMILES:C12=CC(CO)=CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.128
InChIKey:GYDWUKRZQJXBNL-UHFFFAOYSA-N