ID: 82783
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -17.813
InChIKey:KKVTXJLSWQRXEO-UHFFFAOYSA-N
ID: 82784
SMILES:c1c2c(cc(CCCCC)c1)OC1(C)C(C2)C(C(CC=CC(C)(O)C)C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -12.64
InChIKey:JHTPDHVMEXQHNF-UHFFFAOYSA-N
ID: 82785
SMILES:C1CC(C=O)=CC2C1C(C)(C)Oc1cc(CCCCCC)c(OC(=O)C)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -16.431
InChIKey:FTKQCEJENOCOCS-UHFFFAOYSA-N
ID: 82786
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 82787
SMILES:C1(C)(C)CCCC2(C)c3C(c4c(O)cc(CCCCC)cc4O3)CC(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -13.16
InChIKey:LAYMTMGAMYBQPH-UHFFFAOYSA-N
ID: 82788
SMILES:C(CC1C(C)(C)Oc2cc(CCc3ccccc3)cc(O)c21)CC(C(CC=C(C)C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -17.037
InChIKey:IQYPGXLTCSWOAJ-UHFFFAOYSA-N
ID: 82789
SMILES:O=Cc1c(CCCCC)cc2c(c1O)C1CC(C)(O2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -16.128
InChIKey:JOFXMKTXHPBKNG-UHFFFAOYSA-N
ID: 82790
SMILES:CC12CCC(C(C)(O)C)Oc3cc(CCCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.078
InChIKey:XKLJPMUUMKASKH-UHFFFAOYSA-N
ID: 82791
SMILES:c1(O)cc(CCCC)cc2c1C1CC(=C)CCC1C(O)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.651
InChIKey:BPAOFTDXDLTWSB-UHFFFAOYSA-N
ID: 82792
SMILES:CN(CCOc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 385.592
CB1 binding score: -15.623
InChIKey:DIVOWHKZBCJPSF-UHFFFAOYSA-N
ID: 82793
SMILES:O1C(CO)C(O)C(O)C(O)C1Oc1cc2c(cc1CCCCCC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.637
CB1 binding score: -16.175
InChIKey:QUYZBOUQTJUTEM-UHFFFAOYSA-N
ID: 82794
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2=C(O)C(=O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -13.806
InChIKey:NJTYPMLNYSJDPB-UHFFFAOYSA-N
ID: 82795
SMILES:Cc1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.296
InChIKey:VDFPGOHCLBXAJM-UHFFFAOYSA-N
ID: 82796
SMILES:c1(CCCCC)cc2c3c(c1O)OC1(C)CC3C(C(=C)C)CC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.652
InChIKey:YXOIGVGUZZXTFB-UHFFFAOYSA-N
ID: 82797
SMILES:C1C(C)=CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.334
InChIKey:SEXFQAYXMLPWFB-UHFFFAOYSA-N
ID: 82798
SMILES:C12C=C(C(=O)O)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 82799
SMILES:O(C1C2C(c3c(cc(CCC)cc3O)O1)C(O)C(C)(C)C2)C([N+](=O)O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.461
CB1 binding score: -13.116
InChIKey:UZNWZAICJUMQJC-UHFFFAOYSA-O
ID: 82800
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=CCC3(CO3)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.867
InChIKey:QFMZOEHCXHYDIW-UHFFFAOYSA-N
ID: 82801
SMILES:c1(CCCCC)cc2c3c(c1)CC(C(C)=C)CCC(=C)C3(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -18.715
InChIKey:FOBCADHJKVPNPL-UHFFFAOYSA-N
ID: 82802
SMILES:C1(C)=CC2C(CC1)C(CO)(C)Oc1c2cc(O)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.495
InChIKey:KXDAADNEVRLBMT-UHFFFAOYSA-N
ID: 82803
SMILES:c1(CCCCC)c(O)cc(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.968
InChIKey:RNKSQHRRYNTMIO-UHFFFAOYSA-N