ID: 109684
SMILES:C(=O)OC1(c2c(O)cc(CCCCC)cc2OC(C)=O)C(C)(C)C2CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -16.43
InChIKey:NZCJJTNKSCIDQN-UHFFFAOYSA-N
ID: 109685
SMILES:C(=O)(C(CO)=C1C(OC(C)=O)CC2(C)Oc3cc(C)cc(O)c3C(C=C(C)C)C12)NCCc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 519.638
CB1 binding score: -15.369
InChIKey:UQJOGFGOJGOHLF-UHFFFAOYSA-N
ID: 109686
SMILES:C(CCc1cc(O)c2c(c1)OC1(C)CCCC(C)(C)C1C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 302.458
CB1 binding score: -17.684
InChIKey:SQNFBZBGPYOMLU-UHFFFAOYSA-N
ID: 109687
SMILES:O=C1C(C)=CC(c2c(O)cc(CCCCC)cc2OC2C(O)C(OC(C(C)C)=O)C(OC(=O)C=C(C)C)C(C)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.695
CB1 binding score: -13.522
InChIKey:ZTBVWNZDGJXNOZ-UHFFFAOYSA-N
ID: 109688
SMILES:C1c2c(O)cc(C(O)CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -16.672
InChIKey:LRYNVCTZYCLWFX-UHFFFAOYSA-N
ID: 109689
SMILES:C1C(CCC=C(C)C)(C)Oc2cc(C(O)=O)cc(CCCCC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.594
InChIKey:QQWBYCGWSSQMGZ-UHFFFAOYSA-N
ID: 109690
SMILES:C(=O)(c1ccccc1)Oc1cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.577
CB1 binding score: -16.416
InChIKey:QTMPKYKTBVSCSS-UHFFFAOYSA-N
ID: 109691
SMILES:C1=C2C(CC(O)C1(C)CO)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.704
InChIKey:QAXQJDZVWKBYLG-UHFFFAOYSA-N
ID: 109692
SMILES:c1cc(OCC(=C(C)C)OC(C)=O)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -12.168
InChIKey:VJYSHDRZCYFYLM-UHFFFAOYSA-N
ID: 109693
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 109694
SMILES:C12C(OC(C)=O)=C(CCCCC)C(=O)C1C(C)CCC2C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -12.889
InChIKey:OGNRWIXTQOTIKR-UHFFFAOYSA-N
ID: 109695
SMILES:O1C(C(C)(C)CC(=O)CC(C)=CCc2c(O)cc(CCC)cc2O)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.89
InChIKey:SGLVDMVTGBDQKP-UHFFFAOYSA-N
ID: 109696
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 109697
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 109698
SMILES:C(CCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)(O)C1)C(C)=CC1C(=C(C)C)CCC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.717
CB1 binding score: -16.149
InChIKey:KTGYICLYQCZJHC-UHFFFAOYSA-N
ID: 109699
SMILES:CC1COc2cc(CCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 192.258
CB1 binding score: -18.334
InChIKey:QASDEULNINBRNY-UHFFFAOYSA-N
ID: 109700
SMILES:C1(OC)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -18.232
InChIKey:FQCSXIBOQQKQHY-UHFFFAOYSA-N
ID: 109701
SMILES:C(CCC(=CCc1c(O)cc(CCC)cc1O)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 109702
SMILES:C1(CCC=C(COC(C)=O)C(O)=O)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.475
CB1 binding score: -14.1
InChIKey:NLSYMQIJFGXCNV-UHFFFAOYSA-N
ID: 109703
SMILES:C(C1(C)C=Cc2c(O)cc(CCCCC)cc2O1)CC1(C)OC1CO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.02
InChIKey:VAUXYMTYJIQSDC-UHFFFAOYSA-N
ID: 109704
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)C(=O)CC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.144
InChIKey:QVOHZXGDRQEEJT-UHFFFAOYSA-N