ID: 83854
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC3(C)C(CC12)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.608
InChIKey:DIZIBWOZVJVYLY-UHFFFAOYSA-N
ID: 83855
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1CC(O)C(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.12
InChIKey:VUBSZNYPAORBPR-UHFFFAOYSA-N
ID: 83856
SMILES:CC(=CCCC(=CCOCc1cc(CCCCC)cc2c1OC1(C)CCC3C(C)(C)C3C12)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -16.457
InChIKey:VASOUDIQYONJKZ-UHFFFAOYSA-N
ID: 83857
SMILES:CC12CCCC(C)(C)C1C(=O)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.646
InChIKey:BJBFMUNQQXZBTG-UHFFFAOYSA-N
ID: 83858
SMILES:C(CCCc1cc2c(c(O)c1)C1C(CC(=O)C(C)C1)C1C2C(C)CO1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -18.632
InChIKey:OWRJVKPJBYTYLY-UHFFFAOYSA-N
ID: 83859
SMILES:c12c(c(O)cc(CCCCC)c1)C1C=C(CCC=C(C)C)C(OC)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.929
InChIKey:XMTCEJPKBFPAEY-UHFFFAOYSA-N
ID: 83860
SMILES:c12c(c(O)cc(CCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.1
InChIKey:IGHPHANYGIPSNW-UHFFFAOYSA-N
ID: 83861
SMILES:c1(C2C(CCC(C)C)OC(=O)C2)c(O)c2c(cc1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.422
InChIKey:NXWPADSFEPVSIR-UHFFFAOYSA-N
ID: 83862
SMILES:CC(C)C1C(c2c(O)cc(CCCCCO)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.781
InChIKey:CTZSPTCATADZMP-UHFFFAOYSA-N
ID: 83863
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C3COC2(O)CC3(C)C(C)(O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.932
InChIKey:DMNNWPUWTDTZMF-UHFFFAOYSA-N
ID: 83864
SMILES:c1c(CCC(CCCc2ccccc2)C)cc(O)c(C2C(C(C)(C)O)CCC2(C)O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -14.606
InChIKey:XQYGQFDBJCQXPW-UHFFFAOYSA-N
ID: 83865
SMILES:C1(=O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.281
InChIKey:XNTMOCUAPBGYEC-UHFFFAOYSA-N
ID: 83866
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)-c2c1cc(CCCCC)cc2Oc1cc2c(c(O)c1C(=O)C)CCC1C2(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 680.97
CB1 binding score: -12.318
InChIKey:WTAWZLAVNBFABU-UHFFFAOYSA-N
ID: 83867
SMILES:COc1c(CC=C(C)C)c(O)c2c(c1)C1CC(C(O)=O)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.435
InChIKey:ITKNUQZMGGEVPT-UHFFFAOYSA-N
ID: 83868
SMILES:CC1(C)OC1C(O)CC(c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -11.623
InChIKey:QSPSFHANGSSUPI-UHFFFAOYSA-N
ID: 83869
SMILES:C(C)Cc1cc2c(c(C)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -17.193
InChIKey:NNGOXHWZFQNHJF-UHFFFAOYSA-N
ID: 83870
SMILES:c1(O)c(C(=O)C(CC)C)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 83871
SMILES:C12C(C(C)(C)Oc3cc(CCCC)cc4c3C1(O)C(C)CC(C)C4C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.639
InChIKey:ZYZHGNUEJAGURM-UHFFFAOYSA-N
ID: 83872
SMILES:C12(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(COC(C)=O)CC2OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.622
InChIKey:CHEVJLRQCYGWEW-UHFFFAOYSA-N
ID: 83873
SMILES:c1c(COC(CC(C)C)=O)cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.159
InChIKey:JAIFRSZJGWMTER-UHFFFAOYSA-N
ID: 83874
SMILES:C(C)(=O)Oc1c2c(cc(OC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.618
InChIKey:QYZRURXISDSAGQ-UHFFFAOYSA-N